Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9c6f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE GLU 26.A OE1 no hydrogen 3.009 N/A ARG 1.A NH2 GLU 26.A OE1 no hydrogen 2.456 N/A ARG 1.A NH2 GLU 26.A OE2 no hydrogen 3.344 N/A LEU 3.A N GLU 27.A O no hydrogen 2.925 N/A LEU 4.A N TYR 94.A O no hydrogen 2.877 N/A CYS 5.A SG SER 6.A O no hydrogen 3.390 N/A SER 6.A OG PHE 31.A O no hydrogen 3.406 N/A SER 11.A OG HIS 9.A O no hydrogen 3.239 N/A ALA 17.A N VAL 13.A O no hydrogen 2.892 N/A PHE 18.A N VAL 14.A O no hydrogen 2.913 N/A HIS 19.A N GLU 16.A O no hydrogen 3.164 N/A HIS 19.A ND1 PRO 15.A O no hydrogen 2.381 N/A ALA 20.A N ALA 17.A O no hydrogen 3.123 N/A GLU 27.A N ARG 1.A O no hydrogen 2.790 N/A VAL 28.A N ARG 54.A O no hydrogen 3.162 N/A HIS 29.A N LEU 3.A O no hydrogen 3.287 N/A PHE 31.A N CYS 5.A O no hydrogen 2.924 N/A THR 32.A N THR 58.A O no hydrogen 3.374 N/A THR 32.A OG1 ALA 7.A O no hydrogen 2.790 N/A THR 33.A OG1 ALA 64.A O no hydrogen 2.996 N/A ASP 34.A N LEU 63.A O no hydrogen 3.189 N/A SER 35.A N THR 33.A OG1 no hydrogen 3.113 N/A LYS 37.A N SER 35.A OG no hydrogen 3.161 N/A LYS 37.A NZ HIS 9.A O no hydrogen 3.212 N/A LYS 37.A NZ SER 11.A OG no hydrogen 3.279 N/A LYS 37.A NZ LYS 37.A O no hydrogen 2.416 N/A VAL 41.A N ASN 39.A OD1 no hydrogen 3.132 N/A ASN 44.A N PRO 40.A O no hydrogen 2.885 N/A ASP 45.A N VAL 41.A O no hydrogen 2.912 N/A PHE 46.A N VAL 42.A O no hydrogen 2.917 N/A PHE 47.A N LEU 43.A O no hydrogen 2.911 N/A HIS 48.A N ASN 44.A O no hydrogen 2.867 N/A HIS 48.A ND1 ASN 44.A O no hydrogen 2.292 N/A SER 49.A N ASP 45.A O no hydrogen 2.929 N/A SER 49.A OG ASP 45.A O no hydrogen 3.478 N/A SER 49.A OG PHE 46.A O no hydrogen 2.260 N/A LEU 50.A N PHE 47.A O no hydrogen 3.341 N/A VAL 53.A N LEU 50.A O no hydrogen 3.262 N/A ARG 54.A N GLU 26.A O no hydrogen 3.164 N/A SER 56.A OG HIS 29.A ND1 no hydrogen 2.592 N/A THR 58.A N VAL 30.A O no hydrogen 3.418 N/A CYS 60.A N THR 32.A O no hydrogen 3.019 N/A GLY 62.A N ASP 34.A OD2 no hydrogen 2.476 N/A LEU 63.A N CYS 60.A O no hydrogen 3.319 N/A LEU 67.A N ASP 71.A OD2 no hydrogen 3.166 N/A ASN 68.A N ASP 71.A OD2 no hydrogen 3.033 N/A ASN 68.A ND2 ASP 71.A OD1 no hydrogen 3.224 N/A ARG 70.A NH1 ASP 71.A OD1 no hydrogen 2.686 N/A ASP 71.A N ASN 68.A OD1 no hydrogen 3.012 N/A PHE 72.A N ASN 68.A O no hydrogen 3.245 N/A GLU 73.A N GLU 69.A O no hydrogen 2.917 N/A PHE 74.A N ARG 70.A O no hydrogen 2.927 N/A TYR 75.A N ASP 71.A O no hydrogen 2.913 N/A GLN 76.A N PHE 72.A O no hydrogen 2.858 N/A GLU 77.A N GLU 73.A O no hydrogen 2.913 N/A MET 78.A N PHE 74.A O no hydrogen 2.947 N/A LEU 79.A N TYR 75.A O no hydrogen 2.837 N/A TRP 80.A N GLN 76.A O no hydrogen 2.880 N/A GLN 81.A N GLU 77.A O no hydrogen 2.930 N/A TRP 82.A N MET 78.A O no hydrogen 2.893 N/A TYR 83.A N LEU 79.A O no hydrogen 2.876 N/A TYR 83.A OH GLY 116.A O no hydrogen 2.989 N/A LEU 84.A N TRP 80.A O no hydrogen 2.873 N/A THR 85.A N GLN 81.A O no hydrogen 2.909 N/A LYS 86.A NZ SER 56.A OG no hydrogen 2.789 N/A MET 87.A N TYR 83.A O no hydrogen 3.078 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.577 N/A TYR 94.A N VAL 2.A O no hydrogen 2.901 N/A VAL 95.A N SER 119.A O no hydrogen 2.892 N/A CYS 96.A N LEU 4.A O no hydrogen 2.915 N/A CYS 96.A SG PHE 121.A O no hydrogen 3.240 N/A SER 98.A OG VAL 123.A O no hydrogen 2.853 N/A SER 105.A N ILE 101.A O no hydrogen 3.240 N/A SER 105.A OG LYS 102.A O no hydrogen 3.031 N/A ALA 106.A N LYS 102.A O no hydrogen 2.888 N/A SER 107.A N SER 103.A O no hydrogen 2.931 N/A SER 107.A OG GLN 76.A OE1 no hydrogen 2.589 N/A LEU 108.A N MET 104.A O no hydrogen 2.905 N/A GLN 109.A N SER 105.A O no hydrogen 2.909 N/A LYS 110.A N ALA 106.A O no hydrogen 2.909 N/A ALA 111.A N SER 107.A O no hydrogen 2.908 N/A ALA 112.A N LEU 108.A O no hydrogen 2.874 N/A THR 113.A N GLN 109.A O no hydrogen 2.922 N/A THR 113.A OG1 GLU 152.A OE2 no hydrogen 3.217 N/A LEU 114.A N ALA 111.A O no hydrogen 3.128 N/A PHE 115.A N ALA 111.A O no hydrogen 2.701 N/A GLY 116.A N ALA 112.A O no hydrogen 2.871 N/A ALA 117.A N GLU 152.A O no hydrogen 3.041 N/A GLN 118.A N PRO 93.A O no hydrogen 2.517 N/A SER 119.A OG GLU 148.A OE1 no hydrogen 3.006 N/A SER 119.A OG GLU 148.A OE2 no hydrogen 2.823 N/A PHE 121.A N VAL 95.A O no hydrogen 2.920 N/A HIS 122.A N ILE 147.A O no hydrogen 2.903 N/A VAL 123.A N SER 98.A OG no hydrogen 2.546 N/A LEU 124.A N HIS 145.A O no hydrogen 2.938 N/A ASN 127.A ND2 GLN 143.A OE1 no hydrogen 2.385 N/A ASN 128.A N ALA 125.A O no hydrogen 3.433 N/A ARG 130.A N GLU 134.A OE2 no hydrogen 2.712 N/A ARG 130.A NH1 HIS 9.A ND1 no hydrogen 3.241 N/A ASN 131.A N GLU 134.A OE2 no hydrogen 2.563 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.810 N/A GLU 134.A N ASN 131.A O no hydrogen 3.255 N/A PHE 136.A N ILE 132.A O no hydrogen 3.013 N/A ALA 138.A N GLU 134.A O no hydrogen 2.944 N/A LEU 139.A N MET 135.A O no hydrogen 2.865 N/A GLN 140.A N PHE 136.A O no hydrogen 2.954 N/A LYS 141.A N ASP 137.A O no hydrogen 2.397 N/A GLY 142.A N LEU 139.A O no hydrogen 3.318 N/A GLN 143.A N ALA 138.A O no hydrogen 3.036 N/A HIS 145.A N LEU 124.A O no hydrogen 2.876 N/A HIS 145.A NE2 ASP 126.A OD1 no hydrogen 2.847 N/A HIS 145.A NE2 ASP 126.A OD2 no hydrogen 2.814 N/A ILE 147.A N HIS 122.A O no hydrogen 2.903 N/A GLY 154.A N GLU 152.A OE2 no hydrogen 3.161 N/A ARG 159.A NH1 TRP 155.A O no hydrogen 3.361 N/A ARG 159.A NH1 ALA 156.A O no hydrogen 2.343 N/A ARG 159.A NH2 PHE 115.A O no hydrogen 3.556 N/A ARG 159.A NH2 TRP 155.A O no hydrogen 2.512 N/A LYS 162.A N ARG 159.A O no hydrogen 2.941 N/A LYS 163.A N ARG 160.A O no hydrogen 2.943 N/A LEU 165.A N LEU 161.A O no hydrogen 3.169 N/A CYS 171.A SG ASN 175.A O no hydrogen 2.720 N/A ARG 173.A NH1 HIS 61.A O no hydrogen 3.222 N/A LEU 179.A N GLU 77.A OE2 no hydrogen 2.340 N/A LEU 179.A N LYS 177.A O no hydrogen 3.064 N/A ILE 180.A N GLU 77.A OE2 no hydrogen 3.437 N/A SER 181.A OG PRO 178.A O no hydrogen 2.322 N/A LYS 182.A N PRO 178.A O no hydrogen 3.274 N/A LYS 182.A NZ PRO 178.A O no hydrogen 2.893 N/A SER 183.A N LEU 179.A O no hydrogen 2.965 N/A ILE 184.A N ILE 180.A O no hydrogen 2.916 N/A GLU 185.A N SER 181.A O no hydrogen 2.853 N/A GLU 186.A N LYS 182.A O no hydrogen 2.948 N/A ILE 187.A N SER 183.A O no hydrogen 2.977 N/A LEU 188.A N ILE 184.A O no hydrogen 2.875 N/A SER 189.A N GLU 185.A O no hydrogen 2.867 N/A SER 189.A OG GLU 185.A O no hydrogen 2.149 N/A SER 189.A OG GLU 185.A OE1 no hydrogen 3.473 N/A ASN 190.A N GLU 186.A O no hydrogen 2.962 N/A ASN 190.A ND2 ILE 211.A O no hydrogen 2.556 N/A ASN 190.A ND2 LEU 212.A O no hydrogen 2.582 N/A VAL 191.A N ILE 187.A O no hydrogen 2.902 N/A VAL 191.A N LEU 188.A O no hydrogen 2.775 N/A LYS 192.A N LEU 188.A O no hydrogen 2.367 N/A MET 194.A N VAL 191.A O no hydrogen 3.508 N/A GLN 203.A N GLY 199.A O no hydrogen 3.004 N/A LEU 204.A N LYS 200.A O no hydrogen 3.166 N/A SER 208.A OG ASP 585.A OD2 no hydrogen 3.116 N/A LEU 209.A N PHE 206.A O no hydrogen 2.662 N/A ALA 210.A N PRO 207.A O no hydrogen 3.498 N/A ILE 211.A N SER 208.A O no hydrogen 3.191 N/A LEU 212.A N LEU 209.A O no hydrogen 3.171 N/A ALA 216.A N PRO 213.A O no hydrogen 3.154 N/A GLN 217.A N PRO 213.A O no hydrogen 2.918 N/A GLN 217.A NE2 ASN 190.A OD1 no hydrogen 3.549 N/A GLN 218.A N PRO 214.A O no hydrogen 3.334 N/A LEU 220.A N ALA 216.A O no hydrogen 2.996 N/A LEU 220.A N GLN 217.A O no hydrogen 3.210 N/A GLN 221.A N GLN 218.A O no hydrogen 3.299 N/A LEU 222.A N TRP 219.A O no hydrogen 3.377 N/A LEU 224.A N ILE 554.A O no hydrogen 2.381 N/A SER 225.A N ASP 228.A OD2 no hydrogen 3.001 N/A SER 225.A OG ASP 228.A OD2 no hydrogen 2.548 N/A ASP 228.A N SER 225.A O no hydrogen 3.375 N/A ILE 232.A N ASP 228.A O no hydrogen 3.296 N/A GLN 233.A N GLY 229.A O no hydrogen 2.845 N/A GLN 233.A N ALA 230.A O no hydrogen 2.971 N/A ASN 234.A N ALA 230.A O no hydrogen 3.369 N/A ASN 234.A N TRP 231.A O no hydrogen 2.930 N/A LEU 235.A N ILE 232.A O no hydrogen 3.316 N/A LYS 237.A NZ ILE 232.A O no hydrogen 2.257 N/A LYS 237.A NZ GLN 233.A O no hydrogen 3.300 N/A LYS 237.A NZ LEU 235.A O no hydrogen 2.283 N/A ASP 239.A N TYR 327.A O no hydrogen 3.101 N/A HIS 241.A N ASP 239.A OD1 no hydrogen 3.253 N/A HIS 241.A NE2 HIS 243.A NE2 no hydrogen 2.997 N/A HIS 243.A N ASP 531.A O no hydrogen 3.132 N/A HIS 243.A NE2 HIS 241.A NE2 no hydrogen 2.997 N/A LEU 244.A N ARG 331.A O no hydrogen 2.802 N/A GLY 246.A N HIS 243.A O no hydrogen 3.221 N/A THR 249.A OG1 LEU 294.A O no hydrogen 3.570 N/A LEU 254.A N GLY 251.A O no hydrogen 3.211 N/A GLN 256.A N SER 252.A O no hydrogen 2.925 N/A VAL 257.A N LEU 253.A O no hydrogen 2.908 N/A ARG 258.A N LEU 254.A O no hydrogen 2.896 N/A GLY 259.A N ASP 255.A O no hydrogen 2.925 N/A ALA 261.A N ARG 258.A O no hydrogen 3.269 N/A SER 262.A OG ASP 305.A OD1 no hydrogen 2.941 N/A THR 270.A OG1 ASP 268.A OD1 no hydrogen 3.109 N/A GLN 274.A N GLN 274.A OE1 no hydrogen 2.613 N/A TRP 279.A N ILE 276.A O no hydrogen 3.015 N/A SER 282.A N PRO 280.A O no hydrogen 2.880 N/A SER 282.A OG LYS 284.A O no hydrogen 2.594 N/A ILE 286.A N GLN 500.A O no hydrogen 2.792 N/A SER 287.A OG ASP 289.A OD1 no hydrogen 2.318 N/A LYS 290.A N SER 287.A OG no hydrogen 3.148 N/A TYR 291.A N SER 287.A O no hydrogen 2.772 N/A TYR 291.A OH ASP 531.A OD2 no hydrogen 2.906 N/A TYR 291.A OH SER 536.A OG no hydrogen 2.972 N/A MET 292.A N LEU 288.A O no hydrogen 2.987 N/A GLU 293.A N ASP 289.A O no hydrogen 2.929 N/A LEU 294.A N LYS 290.A O no hydrogen 2.876 N/A GLY 295.A N TYR 291.A O no hydrogen 2.945 N/A ASN 296.A N GLU 293.A O no hydrogen 3.276 N/A ASN 298.A ND2 ALA 248.A O no hydrogen 2.319 N/A GLY 299.A N ASN 298.A OD1 no hydrogen 2.388 N/A SER 300.A OG ASN 336.A O no hydrogen 2.167 N/A SER 300.A OG ASN 336.A OD1 no hydrogen 3.372 N/A LYS 301.A NZ ASN 296.A O no hydrogen 3.345 N/A LYS 301.A NZ ASN 298.A O no hydrogen 2.621 N/A CYS 308.A N ASP 305.A OD2 no hydrogen 2.396 N/A CYS 308.A SG VAL 257.A O no hydrogen 3.318 N/A CYS 308.A SG LEU 302.A O no hydrogen 3.270 N/A LEU 309.A N ASP 305.A O no hydrogen 3.091 N/A ILE 310.A N LYS 306.A O no hydrogen 2.919 N/A ARG 311.A N GLY 307.A O no hydrogen 2.914 N/A GLN 312.A N CYS 308.A O no hydrogen 2.888 N/A GLN 312.A NE2 LEU 244.A O no hydrogen 3.614 N/A VAL 313.A N LEU 309.A O no hydrogen 2.922 N/A GLU 314.A N ILE 310.A O no hydrogen 2.950 N/A LEU 315.A N ARG 311.A O no hydrogen 2.882 N/A LEU 316.A N GLN 312.A O no hydrogen 2.904 N/A TYR 317.A N VAL 313.A O no hydrogen 2.936 N/A GLN 318.A N GLU 314.A O no hydrogen 2.906 N/A SER 319.A N LEU 315.A O no hydrogen 2.896 N/A LEU 320.A N LEU 316.A O no hydrogen 2.899 N/A VAL 321.A N TYR 317.A O no hydrogen 2.930 N/A ASN 322.A N GLN 318.A O no hydrogen 2.899 N/A ASP 323.A N LEU 320.A O no hydrogen 3.287 N/A ASN 324.A N VAL 321.A O no hydrogen 3.126 N/A VAL 325.A N LEU 320.A O no hydrogen 3.391 N/A ALA 326.A N LYS 237.A O no hydrogen 3.015 N/A TYR 327.A OH GLU 329.A OE2 no hydrogen 2.691 N/A ALA 328.A N HIS 373.A O no hydrogen 2.892 N/A GLU 329.A N ASP 239.A O no hydrogen 3.153 N/A ILE 330.A N ASN 375.A O no hydrogen 2.872 N/A ARG 331.A N CYS 242.A O no hydrogen 3.220 N/A ARG 331.A NH1 ASP 415.A OD2 no hydrogen 3.163 N/A CYS 332.A N LEU 377.A O no hydrogen 2.911 N/A TYR 337.A N PRO 334.A O no hydrogen 2.911 N/A TYR 337.A OH GLY 299.A O no hydrogen 3.423 N/A ASP 339.A N ARG 344.A O no hydrogen 2.992 N/A LYS 342.A NZ LYS 304.A O no hydrogen 2.297 N/A ASN 343.A N LYS 340.A O no hydrogen 3.119 N/A ARG 344.A N ASP 339.A O no hydrogen 2.779 N/A VAL 349.A N SER 345.A O no hydrogen 3.098 N/A LEU 350.A N ALA 346.A O no hydrogen 2.923 N/A GLN 351.A N TRP 347.A O no hydrogen 2.908 N/A ASP 352.A N VAL 348.A O no hydrogen 2.879 N/A ILE 353.A N VAL 349.A O no hydrogen 2.937 N/A ASN 354.A N LEU 350.A O no hydrogen 2.925 N/A ASN 354.A ND2 CYS 409.A O no hydrogen 3.421 N/A ASP 355.A N GLN 351.A O no hydrogen 2.882 N/A THR 356.A N ASP 352.A O no hydrogen 2.909 N/A THR 356.A OG1 ASP 352.A O no hydrogen 2.461 N/A PHE 357.A N ILE 353.A O no hydrogen 2.966 N/A THR 358.A N ASN 354.A O no hydrogen 2.927 N/A ARG 359.A N ASP 355.A O no hydrogen 2.912 N/A ARG 359.A NH2 GLU 314.A OE2 no hydrogen 2.382 N/A LEU 360.A N THR 356.A O no hydrogen 2.968 N/A ILE 361.A N PHE 357.A O no hydrogen 2.916 N/A THR 362.A N THR 358.A O no hydrogen 2.922 N/A THR 362.A OG1 THR 358.A O no hydrogen 2.672 N/A GLU 363.A N ARG 359.A O no hydrogen 2.930 N/A ALA 364.A N LEU 360.A O no hydrogen 2.932 N/A LYS 365.A N ILE 361.A O no hydrogen 2.892 N/A GLN 366.A N THR 362.A O no hydrogen 2.934 N/A ASN 368.A N LYS 365.A O no hydrogen 3.129 N/A HIS 373.A N ALA 326.A O no hydrogen 2.895 N/A ASN 375.A N ALA 328.A O no hydrogen 2.926 N/A LEU 376.A N ARG 410.A O no hydrogen 3.055 N/A LEU 377.A N ILE 330.A O no hydrogen 2.881 N/A ILE 379.A N CYS 332.A O no hydrogen 2.664 N/A ALA 380.A N ASP 415.A O no hydrogen 3.203 N/A ARG 382.A NH1 LEU 416.A O no hydrogen 2.871 N/A LYS 383.A N SER 381.A OG no hydrogen 2.899 N/A SER 385.A OG SER 385.A O no hydrogen 2.331 N/A SER 389.A OG ASP 387.A OD1 no hydrogen 3.125 N/A ASP 390.A N ASP 387.A O no hydrogen 3.400 N/A ILE 391.A N LEU 388.A O no hydrogen 2.951 N/A LYS 393.A N SER 389.A O no hydrogen 3.244 N/A HIS 394.A N ASP 390.A O no hydrogen 3.082 N/A LEU 395.A N ILE 391.A O no hydrogen 3.055 N/A ALA 396.A N SER 392.A O no hydrogen 2.903 N/A LEU 397.A N LYS 393.A O no hydrogen 2.834 N/A ALA 398.A N HIS 394.A O no hydrogen 2.710 N/A ILE 399.A N LEU 395.A O no hydrogen 2.989 N/A THR 400.A N ALA 396.A O no hydrogen 2.991 N/A THR 400.A OG1 ALA 396.A O no hydrogen 3.152 N/A THR 400.A OG1 LEU 397.A O no hydrogen 2.792 N/A ALA 401.A N LEU 397.A O no hydrogen 2.640 N/A MET 402.A N ALA 398.A O no hydrogen 2.941 N/A MET 402.A N ILE 399.A O no hydrogen 2.951 N/A GLN 403.A N ILE 399.A O no hydrogen 3.052 N/A GLN 404.A NE2 GLU 406.A O no hydrogen 2.374 N/A GLU 406.A N GLN 404.A O no hydrogen 2.564 N/A CYS 409.A SG ASN 354.A O no hydrogen 3.560 N/A ARG 410.A NH1 GLY 405.A O no hydrogen 2.321 N/A VAL 412.A N LEU 376.A O no hydrogen 3.131 N/A VAL 414.A N ALA 442.A O no hydrogen 2.852 N/A GLU 423.A N GLU 420.A O no hydrogen 3.225 N/A THR 424.A OG1 TYR 429.A OH no hydrogen 2.339 N/A ARG 425.A NH1 ASP 452.A O no hydrogen 2.248 N/A ARG 425.A NH2 GLU 420.A OE2 no hydrogen 3.499 N/A SER 427.A N ARG 425.A O no hydrogen 2.416 N/A SER 427.A OG ARG 425.A O no hydrogen 3.169 N/A TYR 428.A OH GLU 423.A OE1 no hydrogen 2.659 N/A TYR 429.A N ALA 426.A O no hydrogen 2.932 N/A HIS 431.A ND1 ASP 432.A OD1 no hydrogen 3.120 N/A HIS 431.A NE2 TYR 428.A O no hydrogen 2.823 N/A ASP 432.A N TYR 429.A O no hydrogen 3.361 N/A LYS 434.A NZ GLU 430.A O no hydrogen 2.305 N/A LYS 434.A NZ GLU 430.A OE2 no hydrogen 3.161 N/A CYS 439.A N ALA 435.A O no hydrogen 3.113 N/A GLY 440.A N VAL 436.A O no hydrogen 3.277 N/A LEU 441.A N VAL 436.A O no hydrogen 3.448 N/A THR 444.A N VAL 414.A O no hydrogen 3.523 N/A THR 444.A OG1 GLU 492.A OE2 no hydrogen 3.540 N/A HIS 446.A N LEU 416.A O no hydrogen 3.206 N/A HIS 446.A NE2 GLU 449.A OE1 no hydrogen 2.354 N/A GLU 449.A N GLU 420.A OE2 no hydrogen 2.713 N/A ASN 450.A N GLU 420.A OE1 no hydrogen 2.465 N/A ASN 450.A N GLU 420.A OE2 no hydrogen 3.417 N/A TRP 457.A N GLU 454.A O no hydrogen 2.798 N/A GLN 458.A N GLN 458.A OE1 no hydrogen 2.557 N/A ALA 459.A N GLY 455.A O no hydrogen 2.930 N/A VAL 460.A N ILE 456.A O no hydrogen 2.883 N/A TYR 461.A N TRP 457.A O no hydrogen 2.924 N/A TYR 461.A OH THR 483.A OG1 no hydrogen 2.763 N/A LEU 463.A N GLN 458.A O no hydrogen 3.100 N/A ALA 465.A N ALA 459.A O no hydrogen 3.214 N/A ARG 466.A N VAL 443.A O no hydrogen 3.044 N/A ARG 467.A NE GLU 492.A OE2 no hydrogen 2.277 N/A ARG 467.A NH1 GLU 329.A OE1 no hydrogen 3.418 N/A ARG 467.A NH1 THR 569.A O no hydrogen 3.131 N/A ARG 467.A NH2 GLU 329.A OE1 no hydrogen 2.786 N/A LEU 468.A N GLY 490.A O no hydrogen 3.198 N/A GLY 469.A N ALA 445.A O no hydrogen 2.784 N/A LEU 474.A N TYR 519.A OH no hydrogen 3.124 N/A ALA 477.A N LEU 474.A O no hydrogen 3.372 N/A LEU 480.A N ALA 477.A O no hydrogen 2.864 N/A MET 481.A N ALA 477.A O no hydrogen 3.229 N/A ARG 482.A N PRO 478.A O no hydrogen 2.957 N/A THR 483.A OG1 TYR 461.A OH no hydrogen 2.763 N/A VAL 484.A N LEU 480.A O no hydrogen 2.912 N/A ILE 485.A N MET 481.A O no hydrogen 2.861 N/A GLU 486.A N ARG 482.A O no hydrogen 2.943 N/A ARG 487.A N THR 483.A O no hydrogen 3.137 N/A LYS 488.A N ILE 485.A O no hydrogen 3.051 N/A ILE 489.A N VAL 484.A O no hydrogen 3.108 N/A GLY 490.A N ARG 466.A O no hydrogen 3.302 N/A VAL 491.A N LEU 525.A O no hydrogen 2.845 N/A GLU 492.A N LEU 468.A O no hydrogen 2.764 N/A MET 493.A N SER 527.A O no hydrogen 2.935 N/A ASN 498.A N CYS 494.A O no hydrogen 3.088 N/A TYR 499.A N PRO 495.A O no hydrogen 2.895 N/A GLN 500.A N TYR 496.A O no hydrogen 2.897 N/A GLN 500.A NE2 PRO 280.A O no hydrogen 3.053 N/A GLN 500.A NE2 SER 536.A O no hydrogen 3.461 N/A ILE 501.A N ALA 497.A O no hydrogen 2.935 N/A LYS 502.A N ASN 498.A O no hydrogen 2.884 N/A GLY 503.A N TYR 499.A O no hydrogen 2.829 N/A MET 507.A N PHE 504.A O no hydrogen 3.122 N/A PHE 510.A N MET 507.A O no hydrogen 3.280 N/A TYR 514.A OH ASN 498.A OD1 no hydrogen 2.643 N/A LYS 517.A NZ GLU 521.A OE2 no hydrogen 3.365 N/A TYR 519.A N PRO 515.A O no hydrogen 2.659 N/A TYR 519.A OH ALA 471.A O no hydrogen 3.398 N/A LEU 520.A N LEU 516.A O no hydrogen 2.906 N/A GLU 521.A N LYS 517.A O no hydrogen 2.907 N/A ALA 522.A N LYS 518.A O no hydrogen 2.905 N/A GLY 523.A N TYR 519.A O no hydrogen 3.034 N/A GLY 523.A N LEU 520.A O no hydrogen 3.144 N/A ILE 524.A N TYR 519.A O no hydrogen 3.030 N/A SER 527.A N VAL 491.A O no hydrogen 2.898 N/A SER 527.A OG VAL 491.A O no hydrogen 2.719 N/A ASN 529.A N MET 493.A O no hydrogen 2.883 N/A ASN 529.A ND2 VAL 528.A O no hydrogen 2.678 N/A THR 530.A OG1 ASP 239.A OD2 no hydrogen 3.227 N/A THR 530.A OG1 HIS 241.A O no hydrogen 3.226 N/A GLY 534.A N GLY 246.A O no hydrogen 2.628 N/A SER 536.A N ASN 532.A O no hydrogen 3.329 N/A SER 536.A OG TYR 291.A OH no hydrogen 2.972 N/A SER 536.A OG ASN 532.A O no hydrogen 2.866 N/A GLY 537.A N GLY 534.A O no hydrogen 2.961 N/A SER 541.A N ASN 539.A OD1 no hydrogen 2.792 N/A SER 541.A OG ASP 323.A OD1 no hydrogen 2.400 N/A GLU 542.A N ASN 539.A OD1 no hydrogen 3.472 N/A ASN 543.A N ASN 539.A O no hydrogen 3.017 N/A LEU 544.A N LEU 540.A O no hydrogen 2.891 N/A LEU 545.A N SER 541.A O no hydrogen 2.896 N/A ILE 546.A N GLU 542.A O no hydrogen 2.900 N/A LEU 547.A N LEU 544.A O no hydrogen 3.456 N/A ALA 548.A N LEU 545.A O no hydrogen 3.214 N/A ASP 549.A N ILE 546.A O no hydrogen 2.869 N/A LEU 550.A N ILE 546.A O no hydrogen 2.878 N/A CYS 551.A N LEU 547.A O no hydrogen 2.894 N/A CYS 551.A SG TYR 514.A O no hydrogen 3.412 N/A ILE 554.A N CYS 551.A O no hydrogen 3.394 N/A SER 555.A N ASP 558.A OD2 no hydrogen 2.523 N/A SER 555.A OG ASP 558.A OD2 no hydrogen 2.522 N/A ARG 556.A N LEU 220.A O no hydrogen 3.261 N/A ARG 556.A NH1 TRP 219.A O no hydrogen 2.380 N/A ARG 556.A NH2 ASP 228.A OD1 no hydrogen 3.375 N/A ARG 556.A NH2 ASP 228.A OD2 no hydrogen 3.389 N/A VAL 559.A N SER 555.A O no hydrogen 3.352 N/A LEU 560.A N ARG 556.A O no hydrogen 2.947 N/A THR 561.A N MET 557.A O no hydrogen 2.902 N/A ILE 562.A N ASP 558.A O no hydrogen 2.920 N/A ILE 563.A N VAL 559.A O no hydrogen 2.980 N/A ARG 564.A N LEU 560.A O no hydrogen 2.913 N/A ARG 564.A NE GLU 568.A OE1 no hydrogen 3.150 N/A ASN 565.A N THR 561.A O no hydrogen 2.873 N/A ASN 565.A ND2 VAL 526.A O no hydrogen 3.619 N/A SER 566.A N ILE 562.A O no hydrogen 2.881 N/A SER 566.A OG ILE 562.A O no hydrogen 2.795 N/A ILE 567.A N ILE 563.A O no hydrogen 2.944 N/A GLU 568.A N ARG 564.A O no hydrogen 2.893 N/A THR 569.A N ASN 565.A O no hydrogen 2.901 N/A THR 569.A OG1 ASN 565.A O no hydrogen 3.049 N/A THR 569.A OG1 SER 566.A O no hydrogen 3.556 N/A ALA 570.A N ILE 567.A O no hydrogen 3.500 N/A PHE 571.A N GLU 329.A OE2 no hydrogen 3.166 N/A HIS 574.A ND1 ASP 575.A OD1 no hydrogen 3.302 N/A ARG 577.A N SER 573.A O no hydrogen 2.920 N/A ARG 577.A NH2 GLU 568.A O no hydrogen 3.411 N/A MET 578.A N HIS 574.A O no hydrogen 2.943 N/A GLU 579.A N ASP 575.A O no hydrogen 2.942 N/A LEU 580.A N PHE 576.A O no hydrogen 2.894 N/A LEU 581.A N ARG 577.A O no hydrogen 2.878 N/A LYS 582.A N MET 578.A O no hydrogen 2.884 N/A PHE 583.A N GLU 579.A O no hydrogen 3.003 N/A PHE 584.A N LEU 580.A O no hydrogen 2.861 N/A ASP 585.A N LEU 581.A O no hydrogen 2.849 N/A ARG 586.A N LYS 582.A O no hydrogen 2.991 N/A LYS 587.A N PHE 583.A O no hydrogen 2.957 N/A ILE 588.A N PHE 584.A O no hydrogen 2.811 N/A TYR 589.A N ASP 585.A O no hydrogen 2.961 N/A ASP 590.A N ARG 586.A O no hydrogen 2.993 N/A VAL 591.A N LYS 587.A O no hydrogen 2.922 N/A CYS 592.A N ILE 588.A O no hydrogen 2.902 N/A LEU 593.A N TYR 589.A O no hydrogen 2.976 N/A LEU 593.A N ASP 590.A O no hydrogen 3.330 N/A ILE 594.A N ASP 590.A O no hydrogen 2.907 N/A SER 595.A N VAL 591.A O no hydrogen 2.954 N/A SER 595.A OG VAL 591.A O no hydrogen 2.584 N/A